2,6-Dihydroxy-4-pyrimidinylphosphonic acid
TL;DR: 2,6-Dihydroxy-4-pyrimidinylphosphonic acid (CAS 4671-76-5) is a chemical compound with molecular formula C4H5N2O5P and molecular weight 191.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dioxo-1H-pyrimidin-6-yl)phosphonic acid
Also Known As: 2,6-Dihydroxy-4-pyrimidinylphosphonic acid, (2,6-dihydroxypyrimidin-4-yl)phosphonic acid, (2,4-dioxo-1H-pyrimidin-6-yl)phosphonic acid, (2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)phosphonic acid, P-(1,2,3,6-Tetrahydro-2,6-dioxo-4-pyrimidinyl)phosphonic acid
| Molecular Formula | C4H5N2O5P |
|---|---|
| Molecular Weight | 191.99 g/mol |
| LogP | -2.9 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.9936 |
| Heavy Atoms | 12 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 4671-76-5 |
|---|---|
| SMILES | C1=C(NC(=O)NC1=O)P(=O)(O)O |
| InChIKey | DJLNMJXRNSBBLY-UHFFFAOYSA-N |
Product Overview
2,6-Dihydroxy-4-pyrimidinylphosphonic acid (CAS 4671-76-5), with molecular formula C4H5N2O5P and molecular weight 191.99 g/mol. IUPAC: (2,4-dioxo-1H-pyrimidin-6-yl)phosphonic acid.
Chemical Property Profile of 2,6-Dihydroxy-4-pyrimidinylphosphonic acid
Property Insights of 2,6-Dihydroxy-4-pyrimidinylphosphonic acid
The XLogP value of -2.9 indicates that 2,6-Dihydroxy-4-pyrimidinylphosphonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-Dihydroxy-4-pyrimidinylphosphonic acid. Following Lipinski's Rule of Five, 2,6-Dihydroxy-4-pyrimidinylphosphonic acid has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6-Dihydroxy-4-pyrimidinylphosphonic acid?
The CAS number of 2,6-Dihydroxy-4-pyrimidinylphosphonic acid is 4671-76-5.
What is the molecular formula of 2,6-Dihydroxy-4-pyrimidinylphosphonic acid?
The molecular formula of 2,6-Dihydroxy-4-pyrimidinylphosphonic acid is C4H5N2O5P.
What is the molecular weight of 2,6-Dihydroxy-4-pyrimidinylphosphonic acid?
The molecular weight of 2,6-Dihydroxy-4-pyrimidinylphosphonic acid is 191.99 g/mol.
Where can I buy 2,6-Dihydroxy-4-pyrimidinylphosphonic acid?
You can request a quote for 2,6-Dihydroxy-4-pyrimidinylphosphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dihydroxy-4-pyrimidinylphosphonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dihydroxy-4-pyrimidinylphosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.